Vitas-M small molecule compound
ethyl 2-amino-4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydro-4H-chromene-3-carboxylate
Catalog ID
STK860392
SMILES CCOC(=O)C1=C(N)OC2=C(C1c1ccc3c(c1)OCO3)C(=O)CC(C2)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H23NO6 MW 385.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23NO6/c1-4-25-20(24)18-16(11-5-6-13-14(7-11)27-10-26-13)17-12(23)8-21(2,3)9-15(17)28-19(18)22/h5-7,16H,4,8-10,22H2,1-3H3InChIKey
NCQILIPFKFJKRW-UHFFFAOYSA-NSynonyms
342397-01-7342397017
CCOC(=O)C1=C(OC2=C(C1C3=CC4=C(C=C3)OCO4)C(=O)CC(C2)(C)C)N
ethyl2amino4(13benzodioxol5yl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
ETHYL2AMINO4(13BENZODIOXOL5YL)77DIMETHYL5OXO68DIHYDRO4HCHROMENE3CARBOXYLATE
ethyl2amino4(benzo(d)(13)dioxol5yl)77dimethyl5oxo5678tetrahydro4Hchromene3carboxylate
InChI=1SC21H23NO6c142520(24)1816(11561314(711)27102613)1712(23)821(23)915(17)2819(18)22h5716H481022H213H3
MFCD00581336
ZINC000000727472
ZINC000000727473
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